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- μ-Benzenebis[N,N'-(1,3-dimethyl-1,3-propanediylidene)bis(2,6-dichlorobenzenaminato)] dicopper(I), benzene adduct, min. 98%
μ-Benzenebis[N,N'-(1,3-dimethyl-1,3-propanediylidene)bis(2,6-dichlorobenzenaminato)] dicopper(I), benzene adduct, min. 98%
Catalog Number
ACM1119821623
Product Name
μ-Benzenebis[N,N'-(1,3-dimethyl-1,3-propanediylidene)bis(2,6-dichlorobenzenaminato)] dicopper(I), benzene adduct, min. 98%
CAS
1119821-62-3
Synonyms
MFCD12911904;1119821-62-3;micro-Benzenebis[N,N'-(1,3-dimethyl-1,3-propanediylidene)bis(2,6-dichlorobenzenaminato)] dicopper(I), benzene adduct;
IUPAC Name
benzene;copper(1+);2,6-dichloroaniline;4-iminopentan-2-ylideneazanide;
Molecular Weight
1047.54g/mol
Molecular Formula
C40H44Cl8Cu2N8;
Canonical SMILES
CC(=N)CC(=[N-])C.CC(=N)CC(=[N-])C.C1=CC=CC=C1.C1=CC(=C(C(=C1)Cl)N)Cl.C1=CC(=C(C(=C1)Cl)N)Cl.C1=CC(=C(C(=C1)Cl)N)Cl.C1=CC(=C(C(=C1)Cl)N)Cl.[Cu+].[Cu+];
InChI
InChI=1S/4C6H5Cl2N.C6H6.2C5H9N2.2Cu/c4*7-4-2-1-3-5(8)6(4)9;1-2-4-6-5-3-1;2*1-4(6)3-5(2)7;;/h4*1-3H,9H2;1-6H;2*6H,3H2,1-2H3;;/q;;;;;2*-1;2*+1;
InChI Key
VKWAMXCEKTUPCV-UHFFFAOYSA-N;
Complexity
201
Covalently-Bonded Unit Count
9
Exact Mass
1045.973g/mol
H-Bond Acceptor
8
H-Bond Donor
6
Heavy Atom Count
58
Monoisotopic Mass
1041.979g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
154A^2
Application
The purpose of μ-Benzenebis[N,N'-(1,3-dimethyl-1,3-propanediylidene)bis(2,6-dichlorobenzenaminato)] dicopper(I), benzene adduct, min. 98%, is to facilitate high-yield C-H amination of unactivated C-H bonds when used in conjunction with 1-adamantylazide. This reaction is significant in organic synthesis, as it enables the efficient conversion of inert hydrocarbons into more reactive amine derivatives, broadening the scope of functionalization available in complex molecule construction.
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